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6004-79-1

6004-79-1 Structure

6004-79-1 Structure
IdentificationBack Directory
[Name]

hexahydro-3,6-methanophthalic anhydride
[CAS]

6004-79-1
[Synonyms]

Einecs 227-852-8
hexahydro-3,6-methanophthalic anhydride
4-Oxatricyclo[5.2.1.02,6]decane-3,5-dione
Hexahydro-4,7-Methanoisobenzofuran-1,3-dione
4,7-Methanoisobenzofuran-1,3-dione, hexahydro-
Bicyclo[2.2.1]heptane-2,3-dicarboxylic anhydride
3a,4,5,6,7,7a-Hexahydro-4,7-methanoisobenzofuran-1,3-dione
[EINECS(EC#)]

227-852-8
[Molecular Formula]

C9H10O3
[MDL Number]

MFCD00143693
[MOL File]

6004-79-1.mol
[Molecular Weight]

166.17
Chemical PropertiesBack Directory
[Boiling point ]

325.2±11.0 °C(Predicted)
[density ]

1.345
[InChI]

InChI=1S/C9H10O3/c10-8-6-4-1-2-5(3-4)7(6)9(11)12-8/h4-7H,1-3H2
[InChIKey]

LQOPXMZSGSTGMF-UHFFFAOYSA-N
[SMILES]

C1(=O)C2C(C3CC2CC3)C(=O)O1
Hazard InformationBack Directory
[Synthesis]

The production method uses maleic anhydride and mixed C5s as raw materials, generates Nadic anhydride by absorbing cyclopentadiene with maleic anhydride directly at a temperature of 0-5°C, and crystallizes to obtain a pure product; and a Cu-Ni/ZnO-ZrO2 or Co-Ni/ZnO-ZrO2 catalyst is added to the generated Nadic anhydride, carrying out a catalytic hydrogenation reaction in a high-pressure autoclave for 4-6 hours at a temperature of 100-140°C and under a hydrogen pressure of 1-4 MPa, the catalyst is filtered after cooling, and reduced pressure distilling to obtain the hexahydro-3,6-methanophthalic anhydride.[1]
synthesis of hexahydro-3,6-methanophthalic anhydride
[References]

[1] Endo-methylene hexahydrophthalic anhydride and production method thereof. Patent EP2495241A1.
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